4-chloranyl-3-piperidin-1-ylsulfonyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide

Systemtic Name: 4-chloranyl-3-piperidin-1-ylsulfonyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide Openeye Name: 4-chloro-3-(1-piperidylsulfonyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide CAS Name: 4-chloro-3-(1-piperidinylsulfonyl)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]benzamide IUPAC Name: 4-chloro-3-piperidin-1-ylsulfonyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide Traditional Name: 4-chloro-3-piperidinosulfonyl-N-[4-(2-pyrimidylsulfamoyl)phenyl]benzamide Formula: C22H22ClN5O5S2 MolecularWeight: 536.02358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)Cl

InChI

InChI=1S/C22H22ClN5O5S2/c23-19-10-5-16(15-20(19)35(32,33)28-13-2-1-3-14-28)21(29)26-17-6-8-18(9-7-17)34(30,31)27-22-24-11-4-12-25-22/h4-12,15H,1-3,13-14H2,(H,26,29)(H,24,25,27)